ethyl 2-[2-(4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 2-[2-(4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamido]benzoate
ethyl 2-[2-(4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | E717-0436 |
| Compound Name: | ethyl 2-[2-(4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indol-3-yl)acetamido]benzoate |
| Molecular Weight: | 390.4 |
| Molecular Formula: | C21 H18 N4 O4 |
| Smiles: | CCOC(c1ccccc1NC(CN1C(c2c(C=N1)c1ccccc1[nH]2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5252 |
| logD: | 2.5184 |
| logSw: | -2.9987 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.646 |
| InChI Key: | PZLWFIAMNHIIMH-UHFFFAOYSA-N |